SCHEMBL28292349

SCHEMBL28292349

[CH2]Cc1cccc2cccc(F)c12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.37
GPR84 Q9NQS5 1/20 0.37
HPGD P15428 2/20 0.36
ALDH1A1 P00352 2/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 2/20 0.36
CYP1A1 P04798 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP1B1 Q16678 1/20 0.36
TAAR1 Q96RJ0 3/20 0.35
HTR2A P28223 3/20 0.34
IDO1 P14902 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HTT P42858 1/20 0.33
CYP2A13 Q16696 1/20 0.32
MAPK1 P28482 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7761134 0.84 ALDH1A1 (0.45) HPGDALDH1A1TSHRHSD17B10CYP1A1
SCHEMBL15210996 0.78 GABRA1 (0.43) FFAR1GPR84HPGDALDH1A1TSHR
SCHEMBL15345556 0.78 TAAR1 (0.45) FFAR1GPR84HPGDALDH1A1TSHR
SCHEMBL4112541 0.75 ALDH1A1 (0.53) FFAR1GPR84HPGDALDH1A1TSHR
SCHEMBL29788341 0.75 ALDH1A1 (0.53) FFAR1GPR84HPGDALDH1A1TSHR
SCHEMBL144863 0.75 IDO1 (0.41) GPR84TAAR1IDO1CYP2A13HTR2C
SCHEMBL95233 0.74
SCHEMBL1971149 0.72 CYP1A2 (0.48) HPGDALDH1A1TSHRHSD17B10CYP1A1
SCHEMBL6870883 0.71 GABRA1 (0.39) FFAR1GPR84ALDH1A1TAAR1IDO1
SCHEMBL5415328 0.71 TAAR1 (0.38) HPGDALDH1A1CYP1A2CYP3A4TAAR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106572659-B Harmful arthropod agent for preventing and eliminating containing amide compound 住友化学株式会社 2019-05-10 CN disclosed